2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide

C19H36NO3P — CID 613401

IUPAC2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide
SMILESCOP(=O)(CC(=O)NC1CC(C)CCC1C(C)C)C1CCCCC1
InChIInChI=1S/C19H36NO3P/c1-14(2)17-11-10-15(3)12-18(17)20-19(21)13-24(22,23-4)16-8-6-5-7-9-16/h14-18H,5-13H2,1-4H3,(H,20,21)
InChIKeyGOYDLLNEUGNIFP-UHFFFAOYSA-N
MW357.48 g/mol
LogP4.82
Rot. Bonds6

About 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide

2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide (PubChem CID 613401) has the molecular formula C19H36NO3P and a molecular weight of 357.48 g/mol. Its IUPAC name is 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide
PubChem CID613401
Molecular FormulaC19H36NO3P
Molecular Weight357.48 g/mol
Exact Mass357.24
IUPAC Name2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide
SMILESCOP(=O)(CC(=O)NC1CC(C)CCC1C(C)C)C1CCCCC1
InChIInChI=1S/C19H36NO3P/c1-14(2)17-11-10-15(3)12-18(17)20-19(21)13-24(22,23-4)16-8-6-5-7-9-16/h14-18H,5-13H2,1-4H3,(H,20,21)
InChIKeyGOYDLLNEUGNIFP-UHFFFAOYSA-N
XLogP4.82
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.48
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

methyl 2-[bis[2-[[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]amino]-2-oxoethyl]amino]acetate
CID 132579395
2-methoxy-N-(5-methyl-2-propan-2-ylcyclohexyl)propanamide
CID 113225650
3-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)butanamide;hydrochloride
CID 119750943
1-(3-methoxypropyl)-3-(5-methyl-2-propan-2-ylcyclohexyl)urea
CID 91447915
3,3-dimethyl-5-[(5-methyl-2-propan-2-ylcyclohexyl)amino]-5-oxopentanoic acid
CID 62934575
3-chloro-2-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)propanamide
CID 55110853
N-[(1S,2R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 100851674
N-(5-methyl-2-propan-2-ylcyclohexyl)-2-phenylmethoxyacetamide
CID 55763891
N-(2-methoxyethyl)-3-[(5-methyl-2-propan-2-ylcyclohexyl)amino]propanamide
CID 115592406
tert-butyl N-[(2S)-2-methoxy-4-[[(1R,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]amino]-4-oxobutyl]carbamate
CID 100664847
2-amino-4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)pentanamide
CID 43707055
(2S)-2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)butanamide;hydrochloride
CID 119304536

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide?
The IUPAC name of 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide (CID 613401) is 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide.
What is the SMILES notation for 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide?
The canonical SMILES for 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide is COP(=O)(CC(=O)NC1CC(C)CCC1C(C)C)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide?
The InChIKey is GOYDLLNEUGNIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36NO3P/c1-14(2)17-11-10-15(3)12-18(17)20-19(21)13-24(22,23-4)16-8-6-5-7-9-16/h14-18H,5-13H2,1-4H3,(H,20,21).
What are the key properties of 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide?
2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide has a molecular weight of 357.48 g/mol, XLogP of 4.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(methoxy)phosphoryl]-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide is sourced from PubChem (CID 613401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).